N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-3-(3-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NC3CCN(CC3)CC(=O)N)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NC3CCN(CC3)CC(=O)N)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O3/c1-33-21-9-5-8-19(14-21)24-22(16-30(28-24)15-18-6-3-2-4-7-18)25(32)27-20-10-12-29(13-11-20)17-23(26)31/h2-9,14,16,20H,10-13,15,17H2,1H3,(H2,26,31)(H,27,32)